1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine

C9H14BrN3 — CID 105200907

IUPAC1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine
SMILESCCC(Cc1cncc(Br)c1)NN
InChIInChI=1S/C9H14BrN3/c1-2-9(13-11)4-7-3-8(10)6-12-5-7/h3,5-6,9,13H,2,4,11H2,1H3
InChIKeyIBFNSHYNPLRRNU-UHFFFAOYSA-N
MW244.14 g/mol
LogP1.63
Rot. Bonds4

About 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine

1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine (PubChem CID 105200907) has the molecular formula C9H14BrN3 and a molecular weight of 244.14 g/mol. Its IUPAC name is 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine.

Molecular Properties

Compound Name1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine
PubChem CID105200907
Molecular FormulaC9H14BrN3
Molecular Weight244.14 g/mol
Exact Mass243.04
IUPAC Name1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine
SMILESCCC(Cc1cncc(Br)c1)NN
InChIInChI=1S/C9H14BrN3/c1-2-9(13-11)4-7-3-8(10)6-12-5-7/h3,5-6,9,13H,2,4,11H2,1H3
InChIKeyIBFNSHYNPLRRNU-UHFFFAOYSA-N
XLogP1.63
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.14
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine
CID 105202011
[1-(5-bromo-3-pyridinyl)-4-methylhexan-2-yl]hydrazine
CID 105334788
3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105244614
4-(5-bromo-3-pyridinyl)-N,N-diethyl-3-hydrazinylbutan-1-amine
CID 105243945
[1-(5-bromo-3-pyridinyl)-4-propoxybutan-2-yl]hydrazine
CID 105334758
1-(5-bromo-3-pyridinyl)propan-2-ylhydrazine
CID 105201192
[1-(5-bromo-3-pyridinyl)-3-(2-methoxyphenyl)propan-2-yl]hydrazine
CID 105204924
1-(5-bromo-3-pyridinyl)-3-ethylpentan-2-amine
CID 105036917
[1-(5-bromo-3-pyridinyl)-3-phenoxypropan-2-yl]hydrazine
CID 105212897
4-(5-bromo-3-pyridinyl)-N,N-diethyl-3-hydrazinyl-2-methylbutan-2-amine
CID 105239177
[1-(5-bromo-3-pyridinyl)-4-(1,3,5-trimethylpyrazol-4-yl)butan-2-yl]hydrazine
CID 105334822
1-(5-bromo-3-pyridinyl)-N-ethyldecan-2-amine
CID 105036977

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine?
The IUPAC name of 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine (CID 105200907) is 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine.
What is the SMILES notation for 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine?
The canonical SMILES for 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine is CCC(Cc1cncc(Br)c1)NN.
What is the InChIKey of 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine?
The InChIKey is IBFNSHYNPLRRNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14BrN3/c1-2-9(13-11)4-7-3-8(10)6-12-5-7/h3,5-6,9,13H,2,4,11H2,1H3.
What are the key properties of 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine?
1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine has a molecular weight of 244.14 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine is sourced from PubChem (CID 105200907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).